TL;DR: Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide (CAS 102571-24-4) is a chemical compound with molecular formula C24H36INO and molecular weight 481.18417 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,3-diphenylpropoxy)ethyl-methyl-di(propan-2-yl)azanium iodide
Also Known As: Diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methylammonium iodide, AMMONIUM, DIISOPROPYL(2-(3,3-DIPHENYLPROPOXY)ETHYL)METHYL-, IODIDE, 2-(3,3-diphenylpropoxy)ethyl-methyl-di(propan-2-yl)azanium;iodide, 2-(3,3-DIPHENYLPROPOXY)ETHYL-METHYL-DIPROPAN-2-YL-AZANIUM IODIDE, 2-(3,3-diphenylpropoxy)ethyl-methyl-di(propan-2-yl)azanium iodide
| Molecular Formula | C24H36INO |
| Molecular Weight | 481.18417 g/mol |
| XLogP | 2.49 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 481.18417 Da |
| Heavy Atoms | 27 |
| Complexity | 340.0 |
| SMILES | CC(C)[N+](C)(CCOCCC(C1=CC=CC=C1)C2=CC=CC=C2)C(C)C.[I-] |
| InChIKey | QHGIPKXRRAGDMI-UHFFFAOYSA-M |
The XLogP value of 2.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide. With a topological polar surface area (TPSA) of 9.2 Ų, Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide is 102571-24-4.
The molecular formula of Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide is C24H36INO.
The molecular weight of Ammonium, diisopropyl(2-(3,3-diphenylpropoxy)ethyl)methyl-, iodide is 481.18417 g/mol.
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